⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28019334 | 0.78 | CYP2C19 (0.35) | — | |
| SCHEMBL27563694 | 0.77 | — | — | |
| SCHEMBL27541741 | 0.77 | — | — | |
| SCHEMBL7648444 | 0.76 | — | — | |
| SCHEMBL16889113 | 0.74 | — | — | |
| SCHEMBL10582494 | 0.74 | — | — | |
| SCHEMBL27402075 | 0.74 | FAAH (0.45) | — | |
| SCHEMBL8746578 | 0.74 | CA1 (0.46) | — | |
| SCHEMBL28601140 | 0.74 | — | — | |
| SCHEMBL10893748 | 0.74 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100503795-C | Water soluble metal processing oil solution composition | NEIOUS CO LTD (JP) | 2009-06-24 | — | — | CN | disclosed |
| CN-100347159-C | Cationic dimeric dyes | CIBA SC HOLDING AG (CH) | 2007-11-07 | — | — | CN | disclosed |
| CN-1761448-A | Cationic dimeric dyes | CIBA SC HOLDING AG (CH) | 2006-04-19 | — | — | CN | disclosed |
| CN-1678284-A | Dyeing method for porous material | CIBA SC HOLDING AG (CH) | 2005-10-05 | — | — | CN | disclosed |
| CN-1633275-A | Method of colouring porous material | CIBA SC HOLDING AG (CH) | 2005-06-29 | — | — | CN | disclosed |
| CN-1615343-A | Yellow cationic dyes for dying of organic material | CIBA SC HOLDING AG (CH) | 2005-05-11 | — | — | CN | disclosed |
| CN-1497045-A | Water soluble metal processing oil solution composition | 株式会社尼欧斯 | 2004-05-19 | — | — | CN | disclosed |
| EP-0759190-A1 | N-ALKYLHYDROXYLAMINE DERIVATIVES AND THEIR USE AS ANTIOXIDANTS IN PHOTOGRAPHIC COLOR DEVELOPERS AND PROCESSING METHODS | EASTMAN KODAK COMPANY (US) | 1997-02-26 | — | — | EP | disclosed |
| WO-1996028761-A1 | N-ALKYLHYDROXYLAMINE DERIVATIVES AND THEIR USE AS ANTIOXIDANTS IN PHOTOGRAPHIC COLOR DEVELOPERS AND PROCESSING METHODS | EASTMAN KODAK COMPANY (US) | 1996-09-19 | — | — | WO | disclosed |